N-tert-butyl-2-(2-methyl-4-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-tert-butyl-2-(2-methyl-4-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-tert-butyl-2-(2-methyl-4-nitro-phenyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-tert-butyl-2-(2-methyl-4-nitrophenyl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-tert-butyl-2-(2-methyl-4-nitrophenyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-tert-butyl-1,3-diketo-2-(2-methyl-4-nitro-phenyl)isoindoline-5-carboxamide Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC(C)(C)C

InChI

InChI=1S/C20H19N3O5/c1-11-9-13(23(27)28)6-8-16(11)22-18(25)14-7-5-12(10-15(14)19(22)26)17(24)21-20(2,3)4/h5-10H,1-4H3,(H,21,24)